CHEMBRIDGE-ZINC01144384 MOE2007 3D CORINA 3.40 0006 02.08.2006 34 35 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 3 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4120 -0.5260 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7900 -1.2330 0.9220 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2560 -0.2060 -0.9880 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.5520 -0.6840 -0.9790 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4330 -0.4410 -1.8790 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.7610 -1.0010 -1.7580 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8930 -1.8480 -0.4820 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2390 -1.7280 0.2720 S 0 0 0 0 0 0 0 0 0 0 0 0 0.7110 -0.4890 1.1890 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0540 -0.6000 1.1740 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6770 -0.2970 0.1750 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7690 -1.0890 2.3710 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1600 -1.2050 2.3580 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8210 -1.6620 3.4790 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1080 -2.0070 4.6150 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7280 -1.8950 4.6330 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0560 -1.4330 3.5210 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0230 -2.6330 6.1470 Br 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9530 0.3600 -1.7160 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4890 -0.1900 -1.7250 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9650 -1.6280 -2.6260 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6530 -1.4320 0.1790 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1240 -2.8840 -0.7300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2130 -0.7310 1.9860 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7170 -0.9370 1.4730 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8970 -1.7520 3.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1770 -2.1660 5.5220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9800 -1.3410 3.5390 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 12 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 25 1 0 0 0 0 7 8 2 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 26 1 0 0 0 0 9 27 1 0 0 0 0 10 11 1 0 0 0 0 10 28 1 0 0 0 0 10 29 1 0 0 0 0 12 13 1 0 0 0 0 12 30 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 31 1 0 0 0 0 17 18 1 0 0 0 0 17 32 1 0 0 0 0 18 19 2 0 0 0 0 18 21 1 0 0 0 0 19 20 1 0 0 0 0 19 33 1 0 0 0 0 20 34 1 0 0 0 0 M END